F7B
Summary
| Name: | 6-chloranyl-2,3-dihydrothiochromen-4-one |
| Formula: | C9 H7 Cl O S |
| Formal charge: | 0 |
| Formula weight: | 198.669 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 6-chloranyl-2,3-dihydrothiochromen-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H7ClOS/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-2,5H,3-4H2 |
| InChIKey | InChI | 1.03 | OKHUUKHZUNKSQA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc2SCCC(=O)c2c1 |
| SMILES | CACTVS | 3.385 | Clc1ccc2SCCC(=O)c2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc2c(cc1Cl)C(=O)CCS2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc2c(cc1Cl)C(=O)CCS2 |
